Vitas-M small molecule compound
(E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}{4-[(2-methylbenzyl)oxy]phenyl}methanolate
Catalog ID
STL046020
SMILES O=C1C(=O)/C(=C(\c2ccc(cc2)OCc2ccccc2C)/[O-])/C(N1CCCn1c[nH+]cc1)c1ccccc1
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C31H29N3O4 MW 507.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O4/c1-22-8-5-6-11-25(22)20-38-26-14-12-24(13-15-26)29(35)27-28(23-9-3-2-4-10-23)34(31(37)30(27)36)18-7-17-33-19-16-32-21-33/h2-6,8-16,19,21,28,35H,7,17-18,20H2,1H3/b29-27+InChIKey
PNYUCUFISDPCLT-ORIPQNMZSA-NSynonyms
843633-89-6(4E)4(HYDROXY(4((2METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)1(3IMIDAZOL1YLPROPYL)5PHENYLPYRROLIDINE23DIONE
(E)(1(3(1Himidazol3ium1yl)propyl)45dioxo2phenylpyrrolidin3ylidene)(4((2methylbenzyl)oxy)phenyl)methanolate
843633896
CC1=CC=CC=C1COC2=CC=C(C=C2)C(=C3C(N(C(=O)C3=O)CCCN4C=CN=C4)C5=CC=CC=C5)O
InChI=1SC31H29N3O4c1228561125(22)203826141224(131526)29(35)2728(2393241023)34(31(37)30(27)36)18717331916322133h2681619212835H7171820H21H3b2927+
MFCD18248765
O=C1C(=O)C(=C(c2ccc(cc2)OCc2ccccc2C)(O))C(N1CCCn1c(nH+)cc1)c1ccccc1
ZINC000102880019
ZINC000102880021
Check stock
See real-time availability and sample size for STL046020 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.